Geometry & MOs

Info

ID:	420057
PubChem CID:	135110936
Reduced:	N2O2C7H9 (2)
Stoich.:	A2B2C7D9 (2)
Weight, g/mol:	287.199762
ΔH_f, kcal/mol:	-43.36
Dipole, Da:	4.76
IP(EA), eV:	-9.82(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5,6-trimethyl-2-(3-propoxypiperidin-1-yl)pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C[C@@H]2CN(C[C@@H]2O)C(=O)CC3=NON=C3C

DOS

IR

Vibrations